Special Topic: Markov Models of Molecular Kinetics
Frank No\'e, Edina Rosta
TL;DR
This collection highlights recent advances in Markov State Models for molecular kinetics, emphasizing their development and application in atomistic simulations to understand molecular behavior.
Contribution
It provides a comprehensive overview of the latest methods and applications of Markov State Models in molecular kinetics research.
Findings
Advances in MSM construction improve accuracy of molecular simulations
MSMs enable detailed kinetic analysis of complex molecular systems
The collection showcases diverse applications of MSMs in chemistry
Abstract
The Journal of Chemical Physics (JCP) article collection on Markov Models of Molecular Kinetics (MMMK) features recent advances developing and using Markov State Models (MSMs) in atomistic molecular simulations and related applications. This editorial provides a brief overview of the state of the art in the field and relates it to the articles in this JCP collection.
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